Structure of PDB 7u1v Chain A Binding Site BS01

Receptor Information
>7u1v Chain A (length=438) Species: 4896 (Schizosaccharomyces pombe) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MKFLNPPFPYSMTSDPESFGHECFTRRWGIILTGIEKDVSERLSKLASTS
KDSEVVAQGKPLLNDLEAFKSDIKNDRPLVPLEGEGQDIVEYNEELKQLD
NASWGNAPWLYSECYYYRRISLIFARYSEWKAYDPFFQQKDSTLKSSRAA
VEELAGRYCLLEEELNSIAKKGDSHIAYMVFVEMAQISLWGNATDLSLLT
NLSYEELQNLQGQKVVEESQKNILVNDFPTVWSKLKDVHNGRIDFVLDNA
GFELYVDLIFAAYLLKAGIAKEIVLHPKDFPWFVSDVLPYDIEYLLTNLD
TIFPTESVTKFATDLRSFSAKGQLRLRTDPFWTTAHYFGRMPDFAAGLLT
ELEKSDMIFFKGDLNYRKLTGDCLWPRTTPFGKTLGPIANAINACALRTC
KADVVVGLPDGLYEKIAKDLPHWERTGKYAVVEFCPKA
Ligand information
Ligand IDNI
InChIInChI=1S/Ni/q+2
InChIKeyVEQPNABPJHWNSG-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ni++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ni+2]
FormulaNi
NameNICKEL (II) ION
ChEMBL
DrugBankDB14204
ZINC
PDB chain7u1v Chain A Residue 501 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7u1v Fission yeast Duf89 and Duf8901 are cobalt/nickel-dependent phosphatase-pyrophosphatases that act via a covalent aspartyl-phosphate intermediate.
Resolution2.1 Å
Binding residue
(original residue number in PDB)		X248 N249 D286
Binding residue
(residue number reindexed from 1)		X248 N249 D286
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.3.-
Gene Ontology
Molecular Function
GO:0004427 inorganic diphosphate phosphatase activity
GO:0016787 hydrolase activity
GO:0016791 phosphatase activity
GO:0046872 metal ion binding
GO:0097023 fructose 6-phosphate aldolase activity
GO:0103026 fructose-1-phosphatase activity
Biological Process
GO:0006974 DNA damage response
GO:0030643 intracellular phosphate ion homeostasis
GO:1990748 cellular detoxification
Cellular Component
GO:0005634 nucleus
GO:0005737 cytoplasm
GO:0005829 cytosol

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7u1v, PDBe:7u1v, PDBj:7u1v
PDBsum7u1v
PubMed35314193
UniProtQ9UT55|ART1A_SCHPO Damage-control phosphatase SPAC806.04c (Gene Name=SPAC806.04c)

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